SCHEMBL4150705

SCHEMBL4150705

Cc1ccc(N(CCC[O])Cc2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.69
CNR2 P34972 10/20 0.48
CNR1 P21554 3/20 0.48
TSHR P16473 1/20 0.47
NR1H2 P55055 1/20 0.47
NR1H3 Q13133 1/20 0.47
BCL2L1 Q07817 1/20 0.43
MCL1 Q07820 1/20 0.43
MCHR1 Q99705 1/20 0.42
NR3C1 P04150 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4170696 0.90 CYP2C19 (0.73) CYP2C19CNR2CNR1TSHRNR1H2
SCHEMBL4162431 0.88 TSHR (0.55) CYP2C19CNR2TSHRNR1H2NR1H3
SCHEMBL4168768 0.83 RAB9A (0.50) CYP2C19TSHRNR1H2NR1H3BCL2L1
SCHEMBL11136763 0.82 CYP2C19 (1.00) CYP2C19CNR2CNR1TSHRNR1H2
SCHEMBL11824339 0.81 CYP2C19 (0.76) CYP2C19CNR2CNR1TSHRNR1H2
SCHEMBL22537839 0.80 CYP2C19 (0.73) CYP2C19CNR2CNR1TSHRNR1H2
SCHEMBL11735496 0.78 CYP2C19 (0.81) CYP2C19CNR2CNR1TSHRNR1H2
SCHEMBL15159187 0.78 CYP2C19 (0.89) CYP2C19CNR2CNR1TSHRNR1H2
SCHEMBL4160244 0.77 TSHR (0.59) CYP2C19CNR2TSHRNR1H2NR1H3
SCHEMBL15456984 0.77 CYP2C19 (0.88) CYP2C19CNR2CNR1TSHRNR1H2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090088438-A1 NEW TYROSINE DERIVATIVES AS PPARy MODULATORS LABORATORIOS SALVAT, S.A. (ES) 2009-04-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090088438-A1 NEW TYROSINE DERIVATIVES AS PPARy MODULATORS PPARG, PPARD, TYRO3 CYP2C19 1337/4885CNR2 109/4885CNR1 100/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.